Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 5/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8413034 | 0.89 | HDAC1 (0.56) | HDAC1HDAC2HDAC3LMNAHIF1A | |
| SCHEMBL9566457 | 0.88 | SMN1; SMN2 (0.55) | HDAC1MAPK1HDAC2CYP11B1CYP11B2 | |
| SCHEMBL11591466 | 0.85 | HDAC1 (0.60) | HDAC1HDAC2HDAC3LMNAHIF1A | |
| SCHEMBL11591085 | 0.85 | HDAC1 (0.60) | HDAC1HDAC2HDAC3LMNAHIF1A | |
| SCHEMBL10483348 | 0.84 | SMN1; SMN2 (0.59) | HDAC1HDAC2HDAC3LMNAHIF1A | |
| SCHEMBL9566608 | 0.83 | NPC1 (0.58) | HDAC1HDAC2HDAC3NPC1RAB9A | |
| SCHEMBL9566519 | 0.81 | AAK1 (0.55) | MAPK1AAK1ABCB1LMNANPC1 | |
| SCHEMBL9566631 | 0.81 | MEN1 (0.56) | HDAC1MAPK1HDAC2HDAC3LMNA | |
| SCHEMBL10483367 | 0.80 | NPC1 (0.51) | HDAC1HDAC2ABCB1HDAC3LMNA | |
| SCHEMBL9566416 | 0.79 | LMNA (0.59) | HDAC1HDAC2HDAC3LMNAHIF1A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4874762-A | TREATING DEMENTIA | NIPPON SHINYAKU CO., LTD. (JP) | 1989-10-17 | — | — | US | claimed |
| EP-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |
| US-4874762-A | TREATING DEMENTIA | NIPPON SHINYAKU CO., LTD. (JP) | 1989-10-17 | — | — | US | disclosed |